N-(4-azanylcyclohexyl)-N-[[2-chloranyl-5-(cyclobutylcarbonylamino)phenyl]methyl]cyclohexanecarboxamide

Systemtic Name: N-(4-azanylcyclohexyl)-N-[[2-chloranyl-5-(cyclobutylcarbonylamino)phenyl]methyl]cyclohexanecarboxamide Openeye Name: N-(4-aminocyclohexyl)-N-[[2-chloro-5-(cyclobutanecarbonylamino)phenyl]methyl]cyclohexanecarboxamide CAS Name: N-(4-aminocyclohexyl)-N-[[2-chloro-5-[[cyclobutyl(oxo)methyl]amino]phenyl]methyl]cyclohexanecarboxamide IUPAC Name: N-(4-aminocyclohexyl)-N-[[2-chloro-5-(cyclobutanecarbonylamino)phenyl]methyl]cyclohexanecarboxamide Traditional Name: N-(4-aminocyclohexyl)-N-[2-chloro-5-(cyclobutanecarbonylamino)benzyl]cyclohexanecarboxamide Formula: C25H36ClN3O2 MolecularWeight: 446.02524

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)N(CC2=C(C=CC(=C2)NC(=O)C3CCC3)Cl)C4CCC(CC4)N

Isomeric SMILES

C1CCC(CC1)C(=O)N(CC2=C(C=CC(=C2)NC(=O)C3CCC3)Cl)C4CCC(CC4)N

InChI

InChI=1S/C25H36ClN3O2/c26-23-14-11-21(28-24(30)17-7-4-8-17)15-19(23)16-29(22-12-9-20(27)10-13-22)25(31)18-5-2-1-3-6-18/h11,14-15,17-18,20,22H,1-10,12-13,16,27H2,(H,28,30)